N-[(4-chlorophenyl)methyl]-3-[(2-fluorophenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-3-[(2-fluorophenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
N-[(4-chlorophenyl)methyl]-3-[(2-fluorophenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K821-0353 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-3-[(2-fluorophenyl)methyl]-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 441.91 |
| Molecular Formula: | C22 H17 Cl F N3 O2 S |
| Smiles: | Cc1c2C(N(Cc3ccccc3F)C=Nc2sc1C(NCc1ccc(cc1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3063 |
| logD: | 4.3056 |
| logSw: | -4.9529 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.654 |
| InChI Key: | ZQEGKTLTISZXBZ-UHFFFAOYSA-N |